| SpectraBase Compound ID | AtE56WNWVX5 |
|---|---|
| InChI | InChI=1S/C90H104N5O26P.C6H15N/c1-59(96)93-75-81(112-61(3)98)77(100)71(55-103-47-63-29-13-5-14-30-63)114-87(75)119-84-79(109-52-68-39-23-10-24-40-68)73(57-105-49-65-33-17-7-18-34-65)117-90(86(84)111-54-70-43-27-12-28-44-70)121-122(101,102)120-80-74(58-106-50-66-35-19-8-20-36-66)115-88(76(94-60(2)97)82(80)113-62(4)99)118-83-78(108-51-67-37-21-9-22-38-67)72(56-104-48-64-31-15-6-16-32-64)116-89(107-46-45-92-95-91)85(83)110-53-69-41-25-11-26-42-69;1-4-7(5-2)6-3/h5-44,71-90,100H,45-58H2,1-4H3,(H,93,96)(H,94,97)(H,101,102);4-6H2,1-3H3/t71-,72-,73-,74+,75-,76+,77-,78+,79+,80+,81-,82+,83+,84+,85-,86-,87+,88-,89+,90-;/m1./s1 |
| InChIKey | MUOUKPQFCLFMHE-ANDQRJAQSA-N |
| Mol Weight | 1804.0 g/mol |
| Molecular Formula | C96H119N6O26P |
| Exact Mass | 1802.791165 g/mol |
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| SpectraBase Spectrum ID | BzOILNSnTjc |
|---|---|
| Name | MUOUKPQFCLFMHE-ANDQRJAQSA-N |
| Compound Number | 35 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C96H119N6O26P |
| InChI | InChI=1S/C90H104N5O26P.C6H15N/c1-59(96)93-75-81(112-61(3)98)77(100)71(55-103-47-63-29-13-5-14-30-63)114-87(75)119-84-79(109-52-68-39-23-10-24-40-68)73(57-105-49-65-33-17-7-18-34-65)117-90(86(84)111-54-70-43-27-12-28-44-70)121-122(101,102)120-80-74(58-106-50-66-35-19-8-20-36-66)115-88(76(94-60(2)97)82(80)113-62(4)99)118-83-78(108-51-67-37-21-9-22-38-67)72(56-104-48-64-31-15-6-16-32-64)116-89(107-46-45-92-95-91)85(83)110-53-69-41-25-11-26-42-69;1-4-7(5-2)6-3/h5-44,71-90,100H,45-58H2,1-4H3,(H,93,96)(H,94,97)(H,101,102);4-6H2,1-3H3/t71-,72-,73-,74+,75-,76+,77-,78+,79+,80+,81-,82+,83+,84+,85-,86-,87+,88-,89+,90-;/m1./s1 |
| InChIKey | MUOUKPQFCLFMHE-ANDQRJAQSA-N |
| Literature Reference Author | J.HANSSON,P.J.GAREGG,S.OSCARSON |
| Literature Reference Citation | J.ORG.CHEM.,66,6234(2001) |
| Literature Reference DOI | 10.1021/jo001302m |
| Solvent | CH2Cl2 |
| Source File Reference | UWVN24578 |